REMARK  Name = BDB013695
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  N   LIG    1        0.313  -0.607   1.315  0.00  0.00    -0.326 N 
ATOM      2  H   LIG    1       -0.006  -1.455   0.860  0.00  0.00    +0.148 HD
ENDROOT
BRANCH   1   3
ATOM      3  C   LIG    1        1.316   0.081   0.656  0.00  0.00    +0.143 A 
ATOM      4  C   LIG    1        2.173  -0.633  -0.342  0.00  0.00    +0.002 A 
ATOM      5  C   LIG    1        1.995  -2.111  -0.548  0.00  0.00    +0.039 C 
ATOM      6  C   LIG    1        3.138  -2.757  -1.337  0.00  0.00    +0.005 C 
ATOM      7  C   LIG    1        3.535  -1.895  -2.528  0.00  0.00    +0.005 C 
ATOM      8  C   LIG    1        3.977  -0.502  -2.075  0.00  0.00    +0.041 C 
ATOM      9  C   LIG    1        3.083   0.086  -1.016  0.00  0.00    +0.025 A 
ATOM     10  C   LIG    1        3.251   1.536  -0.737  0.00  0.00    +0.271 A 
ATOM     11  O   LIG    1        4.072   2.192  -1.375  0.00  0.00    -0.266 OA
ATOM     12  N   LIG    1        2.451   2.055   0.266  0.00  0.00    -0.231 N 
ATOM     13  C   LIG    1        2.531   3.464   0.599  0.00  0.00    +0.176 C 
ATOM     14  N   LIG    1        1.480   1.349   0.922  0.00  0.00    -0.153 NA
ENDBRANCH   1   3
BRANCH   1  15
ATOM     15  C   LIG    1       -0.779   0.096   2.000  0.00  0.00    +0.126 C 
BRANCH  15  16
ATOM     16  C   LIG    1       -1.819   0.687   0.991  0.00  0.00    +0.103 C 
BRANCH  16  17
ATOM     17  C   LIG    1       -2.461  -0.378   0.086  0.00  0.00    -0.029 A 
ATOM     18  C   LIG    1       -2.707  -0.062  -1.263  0.00  0.00    +0.005 A 
ATOM     19  C   LIG    1       -3.274  -0.999  -2.129  0.00  0.00    +0.000 A 
ATOM     20  C   LIG    1       -3.615  -2.264  -1.659  0.00  0.00    +0.000 A 
ATOM     21  C   LIG    1       -3.397  -2.590  -0.323  0.00  0.00    +0.000 A 
ATOM     22  C   LIG    1       -2.829  -1.653   0.545  0.00  0.00    +0.005 A 
ENDBRANCH  16  17
BRANCH  16  24
ATOM     23  C   LIG    1       -2.310   2.882   1.929  0.00  0.00    +0.105 C 
ATOM     24  N   LIG    1       -2.862   1.576   1.566  0.00  0.00    -0.300 NA
ATOM     25  C   LIG    1       -3.589   1.002   2.695  0.00  0.00    +0.105 C 
ENDBRANCH  16  24
ENDBRANCH  15  16
ENDBRANCH   1  15
TORSDOF 5